메뉴 건너뛰기




Volumn 29, Issue 8, 2016, Pages 1225-1251

ToxCast Chemical Landscape: Paving the Road to 21st Century Toxicology

Author keywords

[No Author keywords available]

Indexed keywords

BIOTRANSFORMATION; CAS REGISTRY; CHEMICAL STRUCTURE; ENVIRONMENTAL PROTECTION; EXPERT SYSTEM; HIGH THROUGHPUT SCREENING; HUMAN; IN VITRO STUDY; NONHUMAN; ORGANISATION FOR ECONOMIC CO-OPERATION AND DEVELOPMENT; PHYSICAL CHEMISTRY; REVIEW; TOXCAST CHEMICAL LIBRARY; TOXICOLOGY;

EID: 84982290320     PISSN: 0893228X     EISSN: 15205010     Source Type: Journal    
DOI: 10.1021/acs.chemrestox.6b00135     Document Type: Review
Times cited : (534)

References (55)
  • 1
    • 33845620001 scopus 로고    scopus 로고
    • The ToxCast program for prioritizing toxicity testing of environmental chemicals
    • Dix, D. J., Houck, K. A., Martin, M. T., Richard, A. M., Setzer, R. W., and Kavlock, R. J. (2007) The ToxCast program for prioritizing toxicity testing of environmental chemicals Toxicol. Sci. 95, 5-12 10.1093/toxsci/kfl103
    • (2007) Toxicol. Sci. , vol.95 , pp. 5-12
    • Dix, D.J.1    Houck, K.A.2    Martin, M.T.3    Richard, A.M.4    Setzer, R.W.5    Kavlock, R.J.6
  • 5
    • 39349118236 scopus 로고    scopus 로고
    • Transforming environmental health protection
    • Collins, F. S., Gray, G. M., and Bucher, J. R. (2008) Transforming environmental health protection Science 319, 906-907 10.1126/science.1154619
    • (2008) Science , vol.319 , pp. 906-907
    • Collins, F.S.1    Gray, G.M.2    Bucher, J.R.3
  • 6
    • 84879599189 scopus 로고    scopus 로고
    • Improving the human hazard characterization of chemicals: A Tox21 update
    • Tice, R. R., Austin, C. P., Kavlock, R. J., and Bucher, J. R. (2013) Improving the human hazard characterization of chemicals: a Tox21 update Environ. Health Perspect. 121, 756-765 10.1289/ehp.1205784
    • (2013) Environ. Health Perspect. , vol.121 , pp. 756-765
    • Tice, R.R.1    Austin, C.P.2    Kavlock, R.J.3    Bucher, J.R.4
  • 7
    • 77954699153 scopus 로고    scopus 로고
    • ToxCast on target: In vitro assays and computer modeling show promise for screening chemicals
    • Haynes, R. C. (2010) ToxCast on target: In vitro assays and computer modeling show promise for screening chemicals Environ. Health Perspect. 118, A172 10.1289/ehp.118-a172a
    • (2010) Environ. Health Perspect. , vol.118 , pp. A172
    • Haynes, R.C.1
  • 8
    • 79955484701 scopus 로고    scopus 로고
    • Toxicology in the 21st century - Working our way towards a visionary reality
    • Berg, N., De Wever, B., Fuchs, H. W., Gaca, M., Krul, C., and Roggen, E. L. (2011) Toxicology in the 21st century-Working our way towards a visionary reality Toxicol. In Vitro 25, 874-881 10.1016/j.tiv.2011.02.008
    • (2011) Toxicol. in Vitro , vol.25 , pp. 874-881
    • Berg, N.1    De Wever, B.2    Fuchs, H.W.3    Gaca, M.4    Krul, C.5    Roggen, E.L.6
  • 10
    • 84861408073 scopus 로고    scopus 로고
    • Future challenges to protecting public health from drinking-water contaminants
    • Murphy, E. A., Post, G. B., Buckley, B. T., Lippincott, R. L., and Robson, M. G. (2012) Future challenges to protecting public health from drinking-water contaminants Annu. Rev. Public Health 33, 209-224 10.1146/annurev-publhealth-031811-124506
    • (2012) Annu. Rev. Public Health , vol.33 , pp. 209-224
    • Murphy, E.A.1    Post, G.B.2    Buckley, B.T.3    Lippincott, R.L.4    Robson, M.G.5
  • 16
    • 84884582909 scopus 로고    scopus 로고
    • Evaluation of the toxicity forecasting capability of EPA's ToxCast Phase i data: Can ToxCast in vitro assays predict carcinogenicity?
    • Benigni, R. (2013) Evaluation of the toxicity forecasting capability of EPA's ToxCast Phase I data: Can ToxCast in vitro assays predict carcinogenicity? J. Environ. Sci. Health 31, 201-212 10.1080/10590501.2013.824188
    • (2013) J. Environ. Sci. Health , vol.31 , pp. 201-212
    • Benigni, R.1
  • 17
    • 84892856831 scopus 로고    scopus 로고
    • Analysis of Pfizer compounds in EPA's ToxCast chemicals-assay space
    • Shah, F. and Greene, N. (2014) Analysis of Pfizer compounds in EPA's ToxCast chemicals-assay space Chem. Res. Toxicol. 27, 86-98 10.1021/tx400343t
    • (2014) Chem. Res. Toxicol. , vol.27 , pp. 86-98
    • Shah, F.1    Greene, N.2
  • 22
    • 77952545106 scopus 로고    scopus 로고
    • Apparent activity in high-throughput screening: Origins of compound-dependent assay interference
    • Thorne, N., Auld, D. S., and Inglese, J. (2010) Apparent activity in high-throughput screening: origins of compound-dependent assay interference Curr. Opin. Chem. Biol. 14, 315-324 10.1016/j.cbpa.2010.03.020
    • (2010) Curr. Opin. Chem. Biol. , vol.14 , pp. 315-324
    • Thorne, N.1    Auld, D.S.2    Inglese, J.3
  • 23
    • 84904039881 scopus 로고    scopus 로고
    • Developing scientific confidence in HTS-derived prediction models: Lessons learned from an endocrine case study
    • Cox, L. A. T., Popken, D., Marty, M. S., Rowlands, J. C., Patlewicz, G., Goyak, K. O., and Becker, R. A. (2014) Developing scientific confidence in HTS-derived prediction models: Lessons learned from an endocrine case study Regul. Toxicol. Pharmacol. 69, 443-450 10.1016/j.yrtph.2014.05.010
    • (2014) Regul. Toxicol. Pharmacol. , vol.69 , pp. 443-450
    • Cox, L.A.T.1    Popken, D.2    Marty, M.S.3    Rowlands, J.C.4    Patlewicz, G.5    Goyak, K.O.6    Becker, R.A.7
  • 25
    • 33750245442 scopus 로고    scopus 로고
    • Future of Predictive Toxicology: An Expanded View of "chemical Toxicity" - Future of Toxicology Perspective
    • Richard, A. M. (2006) Future of Predictive Toxicology: An Expanded View of "Chemical Toxicity"-Future of Toxicology Perspective Chem. Res. Toxicol. 19, 1257-1262 10.1021/tx060116u
    • (2006) Chem. Res. Toxicol. , vol.19 , pp. 1257-1262
    • Richard, A.M.1
  • 27
    • 67650729693 scopus 로고    scopus 로고
    • Profiling the Activity of Environmental Chemicals in Prenatal Developmental Toxicity Studies using the U.S. EPA's ToxRefDB
    • Knudsen, T. B., Martin, N. T., Kavlock, R. J., Judson, R. S., Dix, D. J., and Singh, A. V. (2009) Profiling the Activity of Environmental Chemicals in Prenatal Developmental Toxicity Studies using the U.S. EPA's ToxRefDB Reprod. Toxicol. 28, 209-219 10.1016/j.reprotox.2009.03.016
    • (2009) Reprod. Toxicol. , vol.28 , pp. 209-219
    • Knudsen, T.B.1    Martin, N.T.2    Kavlock, R.J.3    Judson, R.S.4    Dix, D.J.5    Singh, A.V.6
  • 28
    • 64049119418 scopus 로고    scopus 로고
    • Profiling chemicals based on chronic toxicity results from the U.S. EPA ToxRef Database
    • Martin, M. T., Judson, R. S., Reif, D. M., Kavlock, R. J., and Dix, D. J. (2009) Profiling chemicals based on chronic toxicity results from the U.S. EPA ToxRef Database Environ. Health. Perspect. 117, 392-399 10.1289/ehp.0800074
    • (2009) Environ. Health. Perspect. , vol.117 , pp. 392-399
    • Martin, M.T.1    Judson, R.S.2    Reif, D.M.3    Kavlock, R.J.4    Dix, D.J.5
  • 29
    • 67649233774 scopus 로고    scopus 로고
    • Profiling the reproductive toxicity of chemicals from multigenerational studies in the toxicity reference database
    • Martin, M. T., Mendez, E., Corum, D. G., Judson, R. S., Kavlock, R. J., Rotroff, D. M., and Dix, D. J. (2009) Profiling the reproductive toxicity of chemicals from multigenerational studies in the toxicity reference database Toxicol. Sci. 110, 181-190 10.1093/toxsci/kfp080
    • (2009) Toxicol. Sci. , vol.110 , pp. 181-190
    • Martin, M.T.1    Mendez, E.2    Corum, D.G.3    Judson, R.S.4    Kavlock, R.J.5    Rotroff, D.M.6    Dix, D.J.7
  • 30
    • 12244257228 scopus 로고    scopus 로고
    • DSSTox Website launch: Improving public access to databases for building structure-toxicity prediction models
    • Richard, A. M. (2004) DSSTox Website launch: Improving public access to databases for building structure-toxicity prediction models Preclinica 2, 103-108
    • (2004) Preclinica , vol.2 , pp. 103-108
    • Richard, A.M.1
  • 33
    • 0032600640 scopus 로고    scopus 로고
    • A knowledge-based approach in designing combinatorial or medicinal chemistry libraries for drug discovery. 1. A qualitative and quantitative characterization of known drug databases
    • Ghose, A. K., Viswanadhan, V. N., and Wendoloski, J. J. (1999) A knowledge-based approach in designing combinatorial or medicinal chemistry libraries for drug discovery. 1. A qualitative and quantitative characterization of known drug databases J. Comb. Chem. 1, 55-68 10.1021/cc9800071
    • (1999) J. Comb. Chem. , vol.1 , pp. 55-68
    • Ghose, A.K.1    Viswanadhan, V.N.2    Wendoloski, J.J.3
  • 34
    • 33645887230 scopus 로고    scopus 로고
    • Critical review of the role of HTS in drug discovery
    • Macarron, R. (2006) Critical review of the role of HTS in drug discovery Drug Discovery Today 11, 277-279 10.1016/j.drudis.2006.02.001
    • (2006) Drug Discovery Today , vol.11 , pp. 277-279
    • MacArron, R.1
  • 35
    • 84947495159 scopus 로고    scopus 로고
    • Ambiguity of non-systematic chemical identifiers within and between small-molecule databases
    • Akhondi, S. A., Muresan, S., Williams, A. J., and Kors, J. A. (2015) Ambiguity of non-systematic chemical identifiers within and between small-molecule databases J. Cheminf. 7, 1-10 10.1186/s13321-015-0102-6
    • (2015) J. Cheminf. , vol.7 , pp. 1-10
    • Akhondi, S.A.1    Muresan, S.2    Williams, A.J.3    Kors, J.A.4
  • 36
    • 80052841737 scopus 로고    scopus 로고
    • A quality alert and call for improved curation of public chemistry databases
    • Williams, A. J. and Ekins, S. (2011) A quality alert and call for improved curation of public chemistry databases Drug Discovery Today 16, 747-750 10.1016/j.drudis.2011.07.007
    • (2011) Drug Discovery Today , vol.16 , pp. 747-750
    • Williams, A.J.1    Ekins, S.2
  • 37
    • 84863531180 scopus 로고    scopus 로고
    • Towards a gold standard: Regarding quality in public domain chemistry databases and approaches to improving the situation
    • Williams, A. J., Ekins, S., and Tkachenko, V. (2012) Towards a gold standard: regarding quality in public domain chemistry databases and approaches to improving the situation Drug Discovery Today 17, 685-701 10.1016/j.drudis.2012.02.013
    • (2012) Drug Discovery Today , vol.17 , pp. 685-701
    • Williams, A.J.1    Ekins, S.2    Tkachenko, V.3
  • 42
    • 74049124426 scopus 로고    scopus 로고
    • Estimation of synthetic accessibility score of drug-like molecules based on molecular complexity and fragment contributions
    • Ertl, P. and Schuffenhauer, A. (2009) Estimation of synthetic accessibility score of drug-like molecules based on molecular complexity and fragment contributions J. Cheminf. 1, 8 10.1186/1758-2946-1-8
    • (2009) J. Cheminf. , vol.1 , pp. 8
    • Ertl, P.1    Schuffenhauer, A.2
  • 43
    • 0037361967 scopus 로고    scopus 로고
    • The Chemistry Development Kit (CDK): An open-source Java library for chemo- and bioinformatics
    • Steinbeck, C., Han, Y., Kuhn, S., Horlacher, O., Luttmann, E., and Willighagen, E. (2003) The Chemistry Development Kit (CDK): An open-source Java library for chemo- and bioinformatics J. Chem. Inf. Model. 43, 493-500 10.1021/ci025584y
    • (2003) J. Chem. Inf. Model. , vol.43 , pp. 493-500
    • Steinbeck, C.1    Han, Y.2    Kuhn, S.3    Horlacher, O.4    Luttmann, E.5    Willighagen, E.6
  • 45
    • 84899752905 scopus 로고    scopus 로고
    • Standardizing benchmark dose calculations to improve science-based decisions in human health assessments
    • Wignall, J. A., Shapiro, A. J., Wright, F. A., Woodruff, T. J., Chiu, W. A., Guyton, K. Z., and Rusyn, I. (2014) Standardizing benchmark dose calculations to improve science-based decisions in human health assessments Environ. Health Pespect. 122, 499-505 10.1289/ehp.1307539
    • (2014) Environ. Health Pespect. , vol.122 , pp. 499-505
    • Wignall, J.A.1    Shapiro, A.J.2    Wright, F.A.3    Woodruff, T.J.4    Chiu, W.A.5    Guyton, K.Z.6    Rusyn, I.7
  • 46
    • 40949161450 scopus 로고    scopus 로고
    • In silico tools for sharing data and knowledge on toxicity and metabolism: Derek for Windows, Meteor, and Vitic
    • Marchant, C. A., Briggs, K. A., and Long, A. (2008) In silico tools for sharing data and knowledge on toxicity and metabolism: Derek for Windows, Meteor, and Vitic Toxicol. Mech. Methods 18, 177-187 10.1080/15376510701857320
    • (2008) Toxicol. Mech. Methods , vol.18 , pp. 177-187
    • Marchant, C.A.1    Briggs, K.A.2    Long, A.3
  • 48
    • 0022400101 scopus 로고
    • Fundamental structural alerts to potential carcinogenicity and non-carcinogenicity
    • Ashby, J. (1985) Fundamental structural alerts to potential carcinogenicity and non-carcinogenicity Environ. Mutagen. 7, 919-921 10.1002/em.2860070613
    • (1985) Environ. Mutagen. , vol.7 , pp. 919-921
    • Ashby, J.1
  • 50
    • 13244266921 scopus 로고    scopus 로고
    • Lead- and drug-like compounds: The rule-of-five revolution
    • Lipinski, C. A. (2004) Lead- and drug-like compounds: the rule-of-five revolution Drug Discovery Today: Technol. 1, 337-341 10.1016/j.ddtec.2004.11.007
    • (2004) Drug Discovery Today: Technol. , vol.1 , pp. 337-341
    • Lipinski, C.A.1
  • 51
    • 84907550197 scopus 로고    scopus 로고
    • Guidance on Grouping of Chemicals
    • Organisation for Economic Co-operation and Development, Paris, France
    • OECD (2014) Guidance on Grouping of Chemicals, OECD Series on Testing and Assessment No. 194, Organisation for Economic Co-operation and Development, Paris, France.
    • (2014) OECD Series on Testing and Assessment No. 194
    • OECD1
  • 54
    • 84890474514 scopus 로고    scopus 로고
    • Framework for identifying chemicals with structural features associated with the potential to act as developmental or reproductive toxicants
    • Wu, S., Fisher, J., Naciff, J., Laufersweiler, M., Lester, C., Daston, G., and Blackburn, K. (2013) Framework for identifying chemicals with structural features associated with the potential to act as developmental or reproductive toxicants Chem. Res. Toxicol. 26, 1840-1861 10.1021/tx400226u
    • (2013) Chem. Res. Toxicol. , vol.26 , pp. 1840-1861
    • Wu, S.1    Fisher, J.2    Naciff, J.3    Laufersweiler, M.4    Lester, C.5    Daston, G.6    Blackburn, K.7


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.